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2005 1
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Page 1
Using reaction mechanism to measure enzyme similarity.
O'Boyle NM, Holliday GL, Almonacid DE, Mitchell JB. O'Boyle NM, et al. J Mol Biol. 2007 May 18;368(5):1484-99. doi: 10.1016/j.jmb.2007.02.065. Epub 2007 Mar 2. J Mol Biol. 2007. PMID: 17400244 Free PMC article.
Random forest models to predict aqueous solubility.
Palmer DS, O'Boyle NM, Glen RC, Mitchell JB. Palmer DS, et al. J Chem Inf Model. 2007 Jan-Feb;47(1):150-8. doi: 10.1021/ci060164k. J Chem Inf Model. 2007. PMID: 17238260
MACiE: a database of enzyme reaction mechanisms.
Holliday GL, Bartlett GJ, Almonacid DE, O'Boyle NM, Murray-Rust P, Thornton JM, Mitchell JB. Holliday GL, et al. Bioinformatics. 2005 Dec 1;21(23):4315-6. doi: 10.1093/bioinformatics/bti693. Epub 2005 Sep 27. Bioinformatics. 2005. PMID: 16188925 Free PMC article.